#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6q s MET 1 N 0.00 1.86 0.59 1.43 1.00 -1.26 -4.99 119.30 117.93 2k6q s MET 1 Ca 0.00 1.64 -0.16 0.00 0.00 0.00 0.00 55.69 57.18 2k6q s MET 1 Cb 0.00 -1.81 -0.04 0.00 0.00 0.00 0.00 34.83 32.98 2k6q s MET 1 CO 0.00 -2.03 1.05 -1.25 0.00 0.00 0.00 175.02 172.79 2k6q s PRO 2 N -4.20 3.38 0.34 2.03 0.04 -1.26 -5.08 135.00 130.26 2k6q s PRO 2 Ca 0.71 1.16 0.04 0.00 0.04 0.00 0.00 61.00 62.95 2k6q s PRO 2 Cb -0.26 -2.04 -0.06 0.00 0.04 0.00 0.00 34.50 32.17 2k6q s PRO 2 CO 0.50 -0.76 0.06 -1.54 0.04 0.00 0.00 177.00 175.30 2k6q s SER 3 N -2.86 2.57 0.21 6.66 1.04 -1.26 -5.16 113.70 114.90 2k6q s SER 3 Ca 0.63 -1.40 0.08 0.00 0.48 0.00 0.00 55.95 55.73 2k6q s SER 3 Cb -0.15 -0.07 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 2k6q s SER 3 CO 0.37 -0.62 0.05 -1.83 0.98 0.00 0.00 173.24 172.19 2k6q s GLU 4 N -3.86 2.53 0.04 4.02 -1.05 -1.26 -5.12 118.70 114.00 2k6q s GLU 4 Ca 0.35 -1.15 -0.01 0.00 -0.15 0.00 0.00 54.97 54.01 2k6q s GLU 4 Cb 0.08 -2.38 0.01 0.00 -0.44 0.00 0.00 34.13 31.41 2k6q s GLU 4 CO 0.15 0.42 0.02 1.63 0.95 0.00 0.00 175.26 178.44 2k6q n LYS 5 N -0.55 -1.03 -4.27 -4.83 5.02 -1.26 -5.04 118.16 106.20 2k6q n LYS 5 Ca -0.08 -0.04 -0.20 0.00 -2.02 0.00 0.00 58.31 55.97 2k6q n LYS 5 Cb 0.57 -0.06 -0.11 0.00 -0.02 0.00 0.00 35.03 35.40 2k6q n LYS 5 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k6q s THR 6 N -0.78 1.52 0.58 -0.18 -4.23 -1.26 -4.83 115.64 106.46 2k6q s THR 6 Ca 0.02 -1.76 0.37 0.00 -1.18 0.00 0.00 61.69 59.14 2k6q s THR 6 Cb -0.00 -1.63 0.55 0.00 1.34 0.00 0.00 72.50 72.75 2k6q s THR 6 CO 0.01 -0.35 1.50 0.15 -0.54 0.00 0.00 174.62 175.40 2k6q h PHE 7 N 3.50 0.00 -0.03 3.99 3.04 -1.94 1.75 116.94 127.24 2k6q h PHE 7 Ca -0.41 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.51 2k6q h PHE 7 Cb 1.20 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.71 2k6q h PHE 7 CO 0.66 0.00 -0.07 1.57 -2.02 0.00 0.00 178.31 178.45 2k6q h LYS 8 N 0.00 0.10 0.00 1.11 2.10 -1.95 -2.58 116.57 115.35 2k6q h LYS 8 Ca 0.66 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 59.24 2k6q h LYS 8 Cb 3.09 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 34.43 2k6q h LYS 8 CO -0.01 0.66 -0.15 1.96 -2.00 0.00 0.00 179.45 179.91 2k6q h GLN 9 N -0.44 0.00 0.00 0.07 1.08 0.16 -3.42 115.11 112.57 2k6q h GLN 9 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2k6q h GLN 9 Cb 0.66 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 2k6q h GLN 9 CO 0.02 0.00 0.00 -2.13 -0.95 0.00 0.00 178.83 175.77 2k6q n ARG 10 N -4.54 0.00 -2.12 1.46 3.00 0.43 -4.35 116.66 110.55 2k6q n ARG 10 Ca -0.02 0.60 -0.43 0.00 -0.00 0.00 0.00 57.85 58.01 2k6q n ARG 10 Cb 0.08 -1.37 -0.03 0.00 0.00 0.00 0.00 32.46 31.15 2k6q n ARG 10 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2k6q s ARG 11 N -2.48 4.12 0.22 -0.14 3.00 -0.97 -4.95 118.95 117.75 2k6q s ARG 11 Ca 0.00 1.98 -0.31 0.00 0.00 0.00 0.00 55.73 57.40 2k6q s ARG 11 Cb 0.00 -3.94 -0.10 0.00 0.00 0.00 0.00 34.95 30.90 2k6q s ARG 11 CO 0.00 -0.89 1.49 -1.12 0.00 0.00 0.00 175.30 174.78 2k6q s SER 12 N 3.20 6.62 0.24 0.23 0.01 -1.26 -4.30 113.70 118.44 2k6q s SER 12 Ca 0.69 2.66 -0.07 0.00 1.31 0.00 0.00 55.95 60.54 2k6q s SER 12 Cb -0.29 -2.61 0.43 0.00 0.21 0.00 0.00 66.02 63.76 2k6q s SER 12 CO 0.26 -0.76 1.64 0.15 0.41 0.00 0.00 173.24 174.95 2k6q h PHE 13 N 5.69 -0.00 -0.12 2.43 3.57 -1.86 1.13 116.94 127.77 2k6q h PHE 13 Ca -0.45 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.14 2k6q h PHE 13 Cb 1.21 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 40.07 2k6q h PHE 13 CO 0.62 -0.22 0.09 0.93 -2.23 0.00 0.00 178.31 177.50 2k6q h GLU 14 N 0.12 0.00 0.00 1.11 5.08 -1.98 0.83 114.58 119.74 2k6q h GLU 14 Ca 0.41 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.56 2k6q h GLU 14 Cb 0.71 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 2k6q h GLU 14 CO -0.63 0.00 -1.09 1.96 -1.00 0.00 0.00 179.01 178.25 2k6q h GLN 15 N 0.00 0.00 0.00 2.33 4.20 0.73 -2.42 115.11 119.95 2k6q h GLN 15 Ca 0.06 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 2k6q h GLN 15 Cb 0.23 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 2k6q h GLN 15 CO -0.00 0.80 -0.67 -0.09 -0.67 0.00 0.00 178.83 178.20 2k6q h ARG 16 N 0.00 0.00 0.12 1.46 2.43 0.17 -2.00 114.38 116.56 2k6q h ARG 16 Ca -0.07 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.82 2k6q h ARG 16 Cb 1.75 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.30 2k6q h ARG 16 CO 0.11 0.30 -1.35 0.28 -1.51 0.00 0.00 179.97 177.80 2k6q h VAL 17 N 0.00 1.36 -0.01 0.20 2.07 0.52 -3.20 116.25 117.19 2k6q h VAL 17 Ca -0.04 -2.97 -0.19 0.00 0.82 0.00 0.00 66.70 64.33 2k6q h VAL 17 Cb 1.31 2.86 0.01 0.00 -1.52 0.00 0.00 31.29 33.96 2k6q h VAL 17 CO 0.04 0.86 -0.72 1.05 0.02 0.00 0.00 177.57 178.82 2k6q h GLU 18 N 0.07 0.51 -0.68 1.57 4.11 -1.49 -2.87 114.58 115.80 2k6q h GLU 18 Ca -0.17 -0.53 0.14 0.00 0.07 0.00 0.00 59.36 58.86 2k6q h GLU 18 Cb 1.98 0.15 -0.10 0.00 0.50 0.00 0.00 28.75 31.28 2k6q h GLU 18 CO 0.18 1.17 0.16 0.22 0.07 0.00 0.00 179.01 180.81 2k6q h ASP 19 N 0.07 0.02 -0.47 3.06 3.58 -1.47 0.13 116.42 121.34 2k6q h ASP 19 Ca -0.09 0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 2k6q h ASP 19 Cb 1.41 0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.62 2k6q h ASP 19 CO 0.14 -0.01 0.24 1.62 -2.88 0.00 0.00 179.24 178.36 2k6q h VAL 20 N 0.27 1.18 -0.93 2.25 3.04 -1.58 -2.62 116.25 117.86 2k6q h VAL 20 Ca 0.37 -0.47 0.25 0.00 -1.01 0.00 0.00 66.70 65.84 2k6q h VAL 20 Cb 0.59 0.63 -0.17 0.00 -2.01 0.00 0.00 31.29 30.33 2k6q h VAL 20 CO -0.46 0.19 0.00 -1.14 -1.01 0.00 0.00 177.57 175.15 2k6q n ARG 21 N -4.66 -0.07 0.01 4.17 0.63 0.45 0.18 116.66 117.36 2k6q n ARG 21 Ca 0.01 1.39 -0.11 0.00 -0.92 0.00 0.00 57.85 58.22 2k6q n ARG 21 Cb 0.10 -2.20 -0.06 0.00 0.45 0.00 0.00 32.46 30.74 2k6q n ARG 21 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2k6q h LEU 22 N 0.00 0.08 -2.49 6.15 3.38 -1.24 0.39 115.31 121.58 2k6q h LEU 22 Ca 0.56 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.46 2k6q h LEU 22 Cb 1.13 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 2k6q h LEU 22 CO -0.88 0.11 -0.02 -0.29 0.09 0.00 0.00 178.44 177.45 2k6q h ILE 23 N 0.04 0.32 0.17 1.22 6.09 0.19 1.46 117.51 126.99 2k6q h ILE 23 Ca 0.02 -0.14 -0.31 0.00 -1.37 0.00 0.00 64.86 63.07 2k6q h ILE 23 Cb 0.05 1.10 0.01 0.00 0.47 0.00 0.00 36.82 38.45 2k6q h ILE 23 CO -0.00 0.02 -1.46 0.03 -3.07 0.00 0.00 178.15 173.67 2k6q h ARG 24 N 0.00 0.35 0.00 2.19 2.47 0.19 0.65 114.38 120.24 2k6q h ARG 24 Ca -0.00 -0.60 0.00 0.00 -1.26 0.00 0.00 59.98 58.12 2k6q h ARG 24 Cb 0.10 0.22 0.00 0.00 -1.65 0.00 0.00 29.97 28.64 2k6q h ARG 24 CO 0.00 1.26 -0.53 -0.85 0.56 0.00 0.00 179.97 180.41 2k6q n GLU 25 N -3.56 0.17 -0.10 0.04 0.28 0.12 -3.27 120.64 114.32 2k6q n GLU 25 Ca -0.15 0.05 -0.21 0.00 -0.16 0.00 0.00 57.16 56.69 2k6q n GLU 25 Cb 1.06 -1.61 -0.07 0.00 1.43 0.00 0.00 31.44 32.25 2k6q n GLU 25 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2k6q n GLN 26 N -1.86 0.44 -3.71 3.44 6.02 0.49 -4.81 117.38 117.39 2k6q n GLN 26 Ca 0.04 0.19 -0.28 0.00 -0.01 0.00 0.00 57.00 56.95 2k6q n GLN 26 Cb 0.40 -1.24 -0.11 0.00 1.02 0.00 0.00 30.24 30.31 2k6q n GLN 26 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2k6q n HIS 27 N -3.98 2.91 0.12 1.08 8.25 0.23 -4.88 115.22 118.95 2k6q n HIS 27 Ca -0.38 -4.17 -0.02 0.00 -0.26 0.00 0.00 57.72 52.90 2k6q n HIS 27 Cb 0.75 -0.53 0.10 0.00 1.12 0.00 0.00 29.99 31.43 2k6q n HIS 27 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2k6q h PRO 28 N 5.03 0.00 -0.90 -0.41 0.13 -1.56 -2.99 132.00 131.29 2k6q h PRO 28 Ca 0.17 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.14 2k6q h PRO 28 Cb 0.74 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.78 2k6q h PRO 28 CO 0.71 0.69 0.20 0.25 -0.23 0.00 0.00 178.00 179.62 2k6q n THR 29 N -3.61 1.86 -4.10 1.56 -2.24 -1.26 -4.84 114.28 101.66 2k6q n THR 29 Ca -0.01 -0.90 -0.15 0.00 -2.27 0.00 0.00 64.05 60.73 2k6q n THR 29 Cb 0.70 -0.57 -0.12 0.00 -2.10 0.00 0.00 70.33 68.24 2k6q n THR 29 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2k6q s LYS 30 N -1.83 0.61 -0.31 -0.78 -0.14 -1.13 -3.35 119.74 112.81 2k6q s LYS 30 Ca 0.30 -0.80 -0.11 0.00 -1.36 0.00 0.00 55.97 53.99 2k6q s LYS 30 Cb 0.24 -0.45 -0.02 0.00 -1.68 0.00 0.00 37.83 35.92 2k6q s LYS 30 CO 0.07 0.09 0.20 0.42 -0.76 0.00 0.00 175.35 175.37 2k6q s ILE 31 N -1.33 5.05 0.26 2.17 -1.09 0.76 -4.90 121.20 122.13 2k6q s ILE 31 Ca -0.07 -0.19 -0.30 0.00 -2.23 0.00 0.00 60.65 57.86 2k6q s ILE 31 Cb -0.10 -3.54 -0.09 0.00 -1.58 0.00 0.00 42.46 37.15 2k6q s ILE 31 CO 0.01 0.09 1.09 -2.16 -1.23 0.00 0.00 174.94 172.73 2k6q s PRO 32 N 1.69 4.65 0.07 2.79 0.04 -1.26 -1.92 135.00 141.07 2k6q s PRO 32 Ca 0.06 1.76 -0.05 0.00 0.04 0.00 0.00 61.00 62.81 2k6q s PRO 32 Cb -0.17 -3.21 -0.02 0.00 0.04 0.00 0.00 34.50 31.14 2k6q s PRO 32 CO 0.09 0.22 0.09 0.14 0.04 0.00 0.00 177.00 177.58 2k6q s VAL 33 N -1.02 0.17 -0.33 -0.36 -7.23 -1.15 -2.85 120.40 107.62 2k6q s VAL 33 Ca 0.45 -1.42 -0.01 0.00 -1.81 0.00 0.00 61.98 59.18 2k6q s VAL 33 Cb -0.31 -1.36 0.12 0.00 0.56 0.00 0.00 36.38 35.38 2k6q s VAL 33 CO 0.39 -0.79 0.16 -0.63 -0.31 0.00 0.00 175.10 173.93 2k6q s ILE 34 N -3.75 0.40 -0.13 -0.62 -1.09 0.29 -3.22 121.20 113.09 2k6q s ILE 34 Ca 0.05 -1.41 -0.21 0.00 -2.23 0.00 0.00 60.65 56.84 2k6q s ILE 34 Cb 0.05 -1.31 -0.03 0.00 -1.58 0.00 0.00 42.46 39.59 2k6q s ILE 34 CO -0.10 -0.81 0.61 -0.63 -1.23 0.00 0.00 174.94 172.78 2k6q s ILE 35 N 1.47 5.08 0.10 2.92 1.01 -1.12 -2.95 121.20 127.71 2k6q s ILE 35 Ca 0.13 1.21 0.06 0.00 0.00 0.00 0.00 60.65 62.05 2k6q s ILE 35 Cb -0.19 -3.94 -0.03 0.00 0.01 0.00 0.00 42.46 38.30 2k6q s ILE 35 CO -0.18 0.23 -0.14 -1.61 0.00 0.00 0.00 174.94 173.23 2k6q s GLU 36 N 1.12 0.96 0.27 2.79 2.02 -0.93 -4.67 118.70 120.26 2k6q s GLU 36 Ca 0.31 -1.14 -0.30 0.00 0.02 0.00 0.00 54.97 53.86 2k6q s GLU 36 Cb -0.16 -0.90 -0.10 0.00 0.10 0.00 0.00 34.13 33.07 2k6q s GLU 36 CO 0.13 0.18 1.43 -0.98 0.02 0.00 0.00 175.26 176.05 2k6q s ARG 37 N -2.33 4.26 0.62 1.61 1.70 -1.26 -2.90 118.95 120.64 2k6q s ARG 37 Ca 0.05 2.33 -0.19 0.00 -0.47 0.00 0.00 55.73 57.45 2k6q s ARG 37 Cb -0.07 -3.09 -0.02 0.00 -0.57 0.00 0.00 34.95 31.20 2k6q s ARG 37 CO 0.03 -0.41 1.32 0.98 -1.08 0.00 0.00 175.30 176.13 2k6q n TYR 38 N 1.95 2.05 -2.04 5.89 4.19 -1.10 -4.84 117.16 123.26 2k6q n TYR 38 Ca 0.05 0.42 -0.30 0.00 3.31 0.00 0.00 57.90 61.38 2k6q n TYR 38 Cb 0.40 -2.30 -0.04 0.00 0.49 0.00 0.00 39.34 37.89 2k6q n TYR 38 CO 0.00 0.00 0.00 -1.59 0.91 0.00 0.00 176.86 176.18 2k6q s LYS 39 N -3.22 2.56 0.00 2.98 -2.85 -1.26 -1.33 119.74 116.62 2k6q s LYS 39 Ca 0.79 0.01 0.00 0.00 -1.00 0.00 0.00 55.97 55.77 2k6q s LYS 39 Cb -0.39 -4.85 0.00 0.00 -2.06 0.00 0.00 37.83 30.53 2k6q s LYS 39 CO 0.43 -3.19 0.00 0.41 0.10 0.00 0.00 175.35 173.10 2k6q n GLY 40 N 6.49 1.68 3.29 0.59 0.00 -1.26 -5.10 105.19 110.88 2k6q n GLY 40 Ca 0.34 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.99 2k6q n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k6q s GLU 41 N -0.04 2.72 -0.08 1.61 -6.30 -0.44 -4.89 118.70 111.28 2k6q s GLU 41 Ca 0.00 -1.11 0.06 0.00 -2.50 0.00 0.00 54.97 51.43 2k6q s GLU 41 Cb 0.00 -3.43 -0.10 0.00 0.00 0.00 0.00 34.13 30.61 2k6q s GLU 41 CO 0.00 -0.61 0.02 0.36 0.02 0.00 0.00 175.26 175.04 2k6q n LYS 42 N 4.82 2.44 0.00 4.30 0.00 -1.26 -4.71 118.16 123.75 2k6q n LYS 42 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.18 2k6q n LYS 42 Cb 0.45 -1.20 0.00 0.00 -0.00 0.00 0.00 35.03 34.28 2k6q n LYS 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2k6q n GLN 43 N -2.35 0.00 -1.68 -1.58 1.13 -1.26 -4.48 117.38 107.16 2k6q n GLN 43 Ca -0.14 0.37 -0.41 0.00 -1.94 0.00 0.00 57.00 54.88 2k6q n GLN 43 Cb 0.75 -0.92 0.01 0.00 0.11 0.00 0.00 30.24 30.19 2k6q n GLN 43 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2k6q n LEU 44 N -0.79 3.76 -4.80 1.08 4.77 -1.26 -4.97 117.00 114.80 2k6q n LEU 44 Ca 0.00 1.08 -0.29 0.00 -0.03 0.00 0.00 56.01 56.77 2k6q n LEU 44 Cb 0.00 -1.47 0.11 0.00 -2.33 0.00 0.00 43.42 39.73 2k6q n LEU 44 CO 0.00 -0.85 0.71 -2.16 -1.33 0.00 0.00 177.39 173.77 2k6q s PRO 45 N -2.19 1.69 -0.23 3.23 0.04 -1.26 -4.97 135.00 131.30 2k6q s PRO 45 Ca 0.62 0.49 -0.29 0.00 0.04 0.00 0.00 61.00 61.86 2k6q s PRO 45 Cb -0.52 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.13 2k6q s PRO 45 CO 0.57 -1.86 1.32 0.08 0.04 0.00 0.00 177.00 177.15 2k6q s VAL 46 N -3.21 4.15 0.41 -0.36 1.01 -1.26 -4.94 120.40 116.19 2k6q s VAL 46 Ca 0.62 1.34 -0.21 0.00 0.00 0.00 0.00 61.98 63.73 2k6q s VAL 46 Cb -0.15 -4.03 -0.15 0.00 0.00 0.00 0.00 36.38 32.05 2k6q s VAL 46 CO 0.54 -0.30 0.11 -0.11 0.00 0.00 0.00 175.10 175.34 2k6q n LEU 47 N 7.24 -2.73 -0.22 3.92 -0.00 -1.26 -4.79 117.00 119.16 2k6q n LEU 47 Ca 0.15 0.81 0.02 0.00 -0.00 0.00 0.00 56.01 56.99 2k6q n LEU 47 Cb 0.46 -0.89 0.13 0.00 -0.00 0.00 0.00 43.42 43.11 2k6q n LEU 47 CO 0.60 -4.14 0.96 -0.78 -0.00 0.00 0.00 177.39 174.03 2k6q h ASP 48 N 0.34 0.12 -4.86 1.96 1.82 -1.92 -3.44 116.42 110.45 2k6q h ASP 48 Ca -0.37 0.11 -0.43 0.00 -0.39 0.00 0.00 57.03 55.94 2k6q h ASP 48 Cb 1.44 0.12 -0.14 0.00 0.68 0.00 0.00 39.33 41.44 2k6q h ASP 48 CO 0.47 0.06 -0.54 -0.54 -1.61 0.00 0.00 179.24 177.08 2k6q s LYS 49 N -6.08 1.65 -0.08 0.28 3.01 -1.26 -5.06 119.74 112.20 2k6q s LYS 49 Ca -0.13 -1.95 0.11 0.00 -1.01 0.00 0.00 55.97 52.99 2k6q s LYS 49 Cb 0.18 -0.04 -0.16 0.00 -1.01 0.00 0.00 37.83 36.80 2k6q s LYS 49 CO 0.75 -0.50 0.14 2.41 0.51 0.00 0.00 175.35 178.66 2k6q n THR 50 N -0.61 0.48 -3.65 2.17 -1.04 -1.26 -4.89 114.28 105.48 2k6q n THR 50 Ca 0.02 -0.41 -0.36 0.00 -2.04 0.00 0.00 64.05 61.25 2k6q n THR 50 Cb 0.64 -0.33 -0.07 0.00 -1.82 0.00 0.00 70.33 68.75 2k6q n THR 50 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2k6q s LYS 51 N -2.52 4.09 -0.00 -2.82 1.02 -1.26 -2.81 119.74 115.44 2k6q s LYS 51 Ca -0.05 -0.02 0.00 0.00 0.02 0.00 0.00 55.97 55.92 2k6q s LYS 51 Cb 0.05 -3.38 0.01 0.00 -0.52 0.00 0.00 37.83 33.99 2k6q s LYS 51 CO 0.50 0.37 0.00 -0.06 -0.92 0.00 0.00 175.35 175.24 2k6q s PHE 52 N 0.11 0.04 -0.45 3.18 0.40 -1.20 -5.05 117.98 115.02 2k6q s PHE 52 Ca 0.14 0.02 -0.12 0.00 -0.60 0.00 0.00 56.93 56.37 2k6q s PHE 52 Cb -0.12 -0.07 0.08 0.00 0.51 0.00 0.00 43.02 43.42 2k6q s PHE 52 CO 0.03 -0.02 0.33 -0.51 0.70 0.00 0.00 175.22 175.75 2k6q s LEU 53 N 0.20 5.43 0.12 -0.37 1.43 -1.26 -2.94 118.68 121.29 2k6q s LEU 53 Ca -0.02 -1.50 -0.19 0.00 -1.03 0.00 0.00 54.13 51.39 2k6q s LEU 53 Cb -0.03 -2.07 -0.07 0.00 0.03 0.00 0.00 46.19 44.05 2k6q s LEU 53 CO -0.01 -0.61 0.61 -0.69 0.23 0.00 0.00 176.35 175.89 2k6q s VAL 54 N 1.50 4.69 0.11 -1.59 1.01 -0.81 -4.87 120.40 120.45 2k6q s VAL 54 Ca 0.04 1.21 -0.30 0.00 0.00 0.00 0.00 61.98 62.93 2k6q s VAL 54 Cb -0.24 -3.89 -0.06 0.00 0.00 0.00 0.00 36.38 32.18 2k6q s VAL 54 CO 0.03 0.44 1.14 -2.16 0.00 0.00 0.00 175.10 174.56 2k6q s PRO 55 N -1.40 4.51 -0.26 2.72 0.04 -1.26 -0.17 135.00 139.17 2k6q s PRO 55 Ca 0.34 1.73 -0.03 0.00 0.04 0.00 0.00 61.00 63.07 2k6q s PRO 55 Cb -0.19 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.06 2k6q s PRO 55 CO 0.20 -0.10 2.66 -0.40 0.04 0.00 0.00 177.00 179.41 2k6q n ASP 56 N 3.20 6.06 -0.47 6.66 3.85 -1.21 -3.32 116.55 131.32 2k6q n ASP 56 Ca 0.06 -2.91 0.00 0.00 -0.71 0.00 0.00 54.79 51.23 2k6q n ASP 56 Cb 0.47 -1.21 0.00 0.00 -1.35 0.00 0.00 41.12 39.02 2k6q n ASP 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2k6q n HIS 57 N 1.16 0.00 -3.56 2.11 1.44 -1.26 -4.94 115.22 110.18 2k6q n HIS 57 Ca 0.36 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.07 2k6q n HIS 57 Cb 0.63 0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.83 2k6q n HIS 57 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 2k6q n VAL 58 N 0.00 0.00 -4.32 0.61 0.24 -1.21 -5.13 118.33 108.51 2k6q n VAL 58 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.01 2k6q n VAL 58 Cb 0.61 0.00 -0.12 0.00 -1.47 0.00 0.00 33.84 32.86 2k6q n VAL 58 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2k6q s ASN 59 N -0.12 3.78 0.62 -1.34 4.22 -1.26 -3.56 114.94 117.28 2k6q s ASN 59 Ca 0.00 -0.61 0.25 0.00 -2.14 0.00 0.00 52.86 50.35 2k6q s ASN 59 Cb 0.00 -0.48 1.10 0.00 1.28 0.00 0.00 41.25 43.15 2k6q s ASN 59 CO 0.00 0.17 1.56 0.00 -2.04 0.00 0.00 177.10 176.79 2k6q h MET 60 N 3.68 0.00 0.47 3.55 -0.00 -1.80 0.15 114.93 120.98 2k6q h MET 60 Ca -0.50 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.19 2k6q h MET 60 Cb 1.17 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.76 2k6q h MET 60 CO 0.45 0.00 -0.32 1.03 -0.00 0.00 0.00 176.91 178.08 2k6q h SER 61 N 0.00 -0.81 -0.90 -0.10 0.87 -1.90 -2.63 113.55 108.09 2k6q h SER 61 Ca 0.27 0.05 0.18 0.00 -1.23 0.00 0.00 61.79 61.06 2k6q h SER 61 Cb 1.90 0.25 -0.17 0.00 -0.44 0.00 0.00 62.40 63.94 2k6q h SER 61 CO -0.00 -0.49 -0.23 -0.33 -0.53 0.00 0.00 176.83 175.25 2k6q h GLU 62 N -0.76 -0.00 -0.90 2.24 5.08 -1.09 1.01 114.58 120.16 2k6q h GLU 62 Ca -0.05 0.00 0.25 0.00 -1.00 0.00 0.00 59.36 58.56 2k6q h GLU 62 Cb 0.64 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.73 2k6q h GLU 62 CO 0.03 -0.00 0.19 1.25 -1.00 0.00 0.00 179.01 179.48 2k6q h LEU 63 N -0.00 -0.11 -0.87 1.33 6.46 -1.54 1.56 115.31 122.14 2k6q h LEU 63 Ca 0.43 0.22 0.05 0.00 -0.12 0.00 0.00 57.88 58.46 2k6q h LEU 63 Cb 0.65 0.32 -0.06 0.00 -0.73 0.00 0.00 40.66 40.84 2k6q h LEU 63 CO -0.92 -0.21 0.55 0.40 -0.62 0.00 0.00 178.44 177.63 2k6q h ILE 64 N 0.15 1.09 -0.32 4.05 1.08 0.11 0.39 117.51 124.06 2k6q h ILE 64 Ca 0.57 -0.36 -0.10 0.00 -0.39 0.00 0.00 64.86 64.59 2k6q h ILE 64 Cb 1.17 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 2k6q h ILE 64 CO -0.72 0.19 -0.21 0.11 -0.69 0.00 0.00 178.15 176.83 2k6q h LYS 65 N 1.04 0.59 -0.46 2.37 1.57 0.23 0.67 116.57 122.59 2k6q h LYS 65 Ca 0.37 -0.22 -0.12 0.00 -1.87 0.00 0.00 60.65 58.81 2k6q h LYS 65 Cb 0.10 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2k6q h LYS 65 CO -0.15 0.76 -0.19 0.82 -0.57 0.00 0.00 179.45 180.12 2k6q h ILE 66 N 0.53 1.27 0.05 1.86 1.08 0.14 -2.14 117.51 120.30 2k6q h ILE 66 Ca 0.08 -1.33 -0.00 0.00 -0.39 0.00 0.00 64.86 63.21 2k6q h ILE 66 Cb 0.65 1.12 0.00 0.00 -3.07 0.00 0.00 36.82 35.52 2k6q h ILE 66 CO 0.05 0.46 -0.02 0.40 -0.69 0.00 0.00 178.15 178.34 2k6q h ILE 67 N 0.80 0.00 -1.75 -0.67 1.08 0.09 -2.41 117.51 114.65 2k6q h ILE 67 Ca 0.11 -0.03 0.51 0.00 -0.39 0.00 0.00 64.86 65.05 2k6q h ILE 67 Cb 0.74 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.42 2k6q h ILE 67 CO 0.06 0.00 1.37 0.08 -0.69 0.00 0.00 178.15 178.97 2k6q h ARG 68 N -0.10 0.00 -0.01 2.37 0.11 -0.97 1.50 114.38 117.29 2k6q h ARG 68 Ca -0.01 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.07 2k6q h ARG 68 Cb 0.05 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.13 2k6q h ARG 68 CO 0.01 0.00 -0.01 0.00 0.10 0.00 0.00 179.97 180.07 2k6q h ARG 69 N 0.00 0.03 -0.62 0.08 2.47 -1.29 0.17 114.38 115.22 2k6q h ARG 69 Ca 0.83 -0.01 0.05 0.00 -1.26 0.00 0.00 59.98 59.58 2k6q h ARG 69 Cb 3.56 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 31.84 2k6q h ARG 69 CO -0.01 0.52 0.41 0.00 0.56 0.00 0.00 179.97 181.45 2k6q h ARG 70 N -0.46 0.66 0.00 0.04 -0.00 0.26 0.22 114.38 115.10 2k6q h ARG 70 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.44 2k6q h ARG 70 Cb 0.51 -0.15 0.00 0.00 0.00 0.00 0.00 29.97 30.33 2k6q h ARG 70 CO 0.00 0.44 -0.20 -0.07 0.00 0.00 0.00 179.97 180.14 2k6q h LEU 71 N 0.68 0.00 -1.90 3.04 3.38 -1.19 -3.46 115.31 115.85 2k6q h LEU 71 Ca 0.26 -0.04 -0.58 0.00 0.09 0.00 0.00 57.88 57.61 2k6q h LEU 71 Cb 0.16 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 40.69 2k6q h LEU 71 CO -0.07 0.02 -0.89 0.00 0.09 0.00 0.00 178.44 177.58 2k6q n GLN 72 N -2.51 -0.90 -1.94 1.13 10.64 0.78 -4.89 117.38 119.69 2k6q n GLN 72 Ca 0.04 0.09 -0.30 0.00 -1.83 0.00 0.00 57.00 55.01 2k6q n GLN 72 Cb 0.47 -3.54 0.21 0.00 -0.86 0.00 0.00 30.24 26.52 2k6q n GLN 72 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2k6q n LEU 73 N -4.23 0.00 0.00 2.61 4.77 -1.20 -5.06 117.00 113.89 2k6q n LEU 73 Ca -0.22 -1.49 -0.17 0.00 -0.03 0.00 0.00 56.01 54.09 2k6q n LEU 73 Cb 0.60 -1.04 -0.04 0.00 -2.33 0.00 0.00 43.42 40.62 2k6q n LEU 73 CO 0.81 -1.47 -0.13 0.59 -1.33 0.00 0.00 177.39 175.87 2k6q n ASN 74 N -3.87 2.71 -0.06 -1.43 3.02 -1.26 -4.99 115.26 109.37 2k6q n ASN 74 Ca 0.17 -2.20 -0.03 0.00 -0.03 0.00 0.00 54.58 52.49 2k6q n ASN 74 Cb 0.59 0.20 0.20 0.00 -0.61 0.00 0.00 39.78 40.16 2k6q n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k6q h ALA 75 N 1.15 1.16 -0.87 5.41 0.00 -2.03 -2.25 119.26 121.83 2k6q h ALA 75 Ca -0.23 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2k6q h ALA 75 Cb 0.69 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2k6q h ALA 75 CO 0.37 0.54 0.49 -0.97 0.00 0.00 0.00 179.25 179.68 2k6q h ASN 76 N 0.64 1.08 -3.40 0.00 -1.24 -2.05 -3.39 115.58 107.23 2k6q h ASN 76 Ca 0.12 -0.09 -0.60 0.00 0.71 0.00 0.00 56.30 56.44 2k6q h ASN 76 Cb 0.46 -0.27 -0.10 0.00 0.73 0.00 0.00 38.32 39.13 2k6q h ASN 76 CO 0.02 0.86 0.34 -1.58 -1.29 0.00 0.00 177.43 175.79 2k6q s GLN 77 N -5.82 4.09 0.06 6.67 2.00 -0.85 -5.04 119.66 120.76 2k6q s GLN 77 Ca -0.12 0.69 -0.16 0.00 -2.00 0.00 0.00 55.36 53.77 2k6q s GLN 77 Cb 0.17 -3.67 -0.06 0.00 0.80 0.00 0.00 33.01 30.24 2k6q s GLN 77 CO 0.82 -0.53 0.50 0.00 -0.50 0.00 0.00 175.29 175.58 2k6q s ALA 78 N 2.76 3.63 -0.03 1.58 0.00 -1.26 -4.32 121.76 124.13 2k6q s ALA 78 Ca 0.31 -0.10 -0.01 0.00 0.00 0.00 0.00 51.96 52.16 2k6q s ALA 78 Cb -0.15 -2.51 0.02 0.00 0.00 0.00 0.00 23.12 20.48 2k6q s ALA 78 CO 0.09 0.45 0.06 0.12 0.00 0.00 0.00 175.76 176.48 2k6q s PHE 79 N -1.16 -0.04 -0.06 0.00 5.36 -1.26 -4.09 117.98 116.73 2k6q s PHE 79 Ca 0.28 0.19 -0.02 0.00 -0.96 0.00 0.00 56.93 56.42 2k6q s PHE 79 Cb -0.18 -0.10 0.04 0.00 -0.34 0.00 0.00 43.02 42.45 2k6q s PHE 79 CO 0.17 -0.07 0.13 -0.06 -1.46 0.00 0.00 175.22 173.92 2k6q s PHE 80 N 0.62 -0.14 -0.29 10.12 0.08 0.36 -4.94 117.98 123.80 2k6q s PHE 80 Ca -0.05 0.44 -0.16 0.00 0.12 0.00 0.00 56.93 57.28 2k6q s PHE 80 Cb -0.07 -0.12 -0.03 0.00 -0.57 0.00 0.00 43.02 42.23 2k6q s PHE 80 CO -0.02 -0.16 0.44 -1.17 -0.10 0.00 0.00 175.22 174.20 2k6q s LEU 81 N 1.24 4.13 -0.32 -0.37 2.96 -1.26 -1.80 118.68 123.27 2k6q s LEU 81 Ca -0.08 0.24 -0.16 0.00 -0.22 0.00 0.00 54.13 53.91 2k6q s LEU 81 Cb -0.12 -2.51 -0.02 0.00 0.50 0.00 0.00 46.19 44.04 2k6q s LEU 81 CO -0.06 -0.28 0.42 -0.76 -1.32 0.00 0.00 176.35 174.35 2k6q s LEU 82 N 2.19 4.26 -0.41 -0.68 2.01 0.19 -4.03 118.68 122.21 2k6q s LEU 82 Ca 0.17 0.04 -0.24 0.00 0.01 0.00 0.00 54.13 54.11 2k6q s LEU 82 Cb -0.16 -2.46 0.02 0.00 0.01 0.00 0.00 46.19 43.61 2k6q s LEU 82 CO 0.11 -0.32 0.85 -0.69 1.01 0.00 0.00 176.35 177.30 2k6q s VAL 83 N 2.16 4.61 -0.21 -1.59 1.01 0.40 -0.34 120.40 126.44 2k6q s VAL 83 Ca 0.15 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.95 2k6q s VAL 83 Cb -0.16 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.90 2k6q s VAL 83 CO 0.11 -0.63 0.00 0.59 0.00 0.00 0.00 175.10 175.18 2k6q n ASN 84 N 6.77 -4.57 0.00 3.32 3.02 -0.33 -1.27 115.26 122.20 2k6q n ASN 84 Ca 0.05 0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2k6q n ASN 84 Cb 0.48 -2.24 0.00 0.00 -0.61 0.00 0.00 39.78 37.41 2k6q n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k6q n GLY 85 N -0.98 0.87 3.05 7.41 0.00 -1.22 -5.00 105.19 109.31 2k6q n GLY 85 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 2k6q n GLY 85 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k6q s HIS 86 N -2.00 1.62 1.22 1.61 -3.43 -0.40 -4.97 115.29 108.93 2k6q s HIS 86 Ca 0.00 -0.61 -0.16 0.00 -0.80 0.00 0.00 55.06 53.49 2k6q s HIS 86 Cb 0.00 -1.16 0.26 0.00 -1.43 0.00 0.00 32.58 30.25 2k6q s HIS 86 CO 0.00 -0.30 0.69 -1.13 -2.00 0.00 0.00 174.74 172.00 2k6q n SER 87 N 3.77 -2.49 -2.14 7.38 3.41 -1.26 0.15 113.62 122.44 2k6q n SER 87 Ca -0.22 -0.32 -0.24 0.00 -0.26 0.00 0.00 58.87 57.82 2k6q n SER 87 Cb 0.52 -1.10 0.02 0.00 -0.26 0.00 0.00 64.21 63.39 2k6q n SER 87 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 2k6q n MET 88 N -4.25 3.52 -0.70 4.33 0.00 -1.26 -4.60 117.12 114.16 2k6q n MET 88 Ca 0.04 -4.22 0.53 0.00 0.00 0.00 0.00 57.70 54.04 2k6q n MET 88 Cb 0.56 -2.25 0.81 0.00 0.00 0.00 0.00 33.22 32.34 2k6q n MET 88 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 2k6q n VAL 89 N -0.65 -0.01 -3.97 3.17 0.24 -1.26 -3.00 118.33 112.84 2k6q n VAL 89 Ca 0.42 1.50 -0.33 0.00 -2.04 0.00 0.00 64.34 63.89 2k6q n VAL 89 Cb 0.90 -2.50 -0.14 0.00 -1.47 0.00 0.00 33.84 30.63 2k6q n VAL 89 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2k6q s SER 90 N -3.88 4.80 -0.77 -1.34 0.01 -1.26 -5.04 113.70 106.22 2k6q s SER 90 Ca -0.05 -1.77 -0.05 0.00 1.31 0.00 0.00 55.95 55.38 2k6q s SER 90 Cb 0.27 -1.66 0.20 0.00 0.21 0.00 0.00 66.02 65.04 2k6q s SER 90 CO 0.89 -0.34 0.65 0.54 0.41 0.00 0.00 173.24 175.38 2k6q s VAL 91 N 1.06 4.45 -0.09 3.43 0.11 -1.16 -4.77 120.40 123.43 2k6q s VAL 91 Ca 0.02 -3.13 0.13 0.00 -2.93 0.00 0.00 61.98 56.07 2k6q s VAL 91 Cb -0.20 -3.80 0.19 0.00 -1.53 0.00 0.00 36.38 31.04 2k6q s VAL 91 CO -0.05 -0.99 1.08 -0.24 -3.33 0.00 0.00 175.10 171.57 2k6q n SER 92 N 3.23 1.80 -4.11 3.54 2.88 -1.26 -4.88 113.62 114.82 2k6q n SER 92 Ca 0.14 -2.68 -0.19 0.00 -1.33 0.00 0.00 58.87 54.80 2k6q n SER 92 Cb 0.40 -0.32 -0.14 0.00 -0.75 0.00 0.00 64.21 63.40 2k6q n SER 92 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2k6q s THR 93 N -2.02 0.99 0.33 2.46 2.01 -1.26 -5.11 115.64 113.04 2k6q s THR 93 Ca 0.21 -0.86 -0.27 0.00 0.31 0.00 0.00 61.69 61.08 2k6q s THR 93 Cb 0.18 -0.89 -0.09 0.00 0.01 0.00 0.00 72.50 71.71 2k6q s THR 93 CO 0.02 0.03 1.07 -2.16 -0.69 0.00 0.00 174.62 172.89 2k6q s PRO 94 N -0.94 4.43 0.63 4.92 0.04 -1.26 -2.83 135.00 139.99 2k6q s PRO 94 Ca 0.01 1.65 0.27 0.00 0.04 0.00 0.00 61.00 62.98 2k6q s PRO 94 Cb -0.07 -2.90 1.41 0.00 0.04 0.00 0.00 34.50 32.98 2k6q s PRO 94 CO 0.01 0.07 1.81 0.97 0.04 0.00 0.00 177.00 179.89 2k6q h ILE 95 N 2.68 0.15 -0.44 0.56 6.09 -1.82 0.78 117.51 125.51 2k6q h ILE 95 Ca -0.47 0.00 -0.12 0.00 -1.37 0.00 0.00 64.86 62.90 2k6q h ILE 95 Cb 1.21 0.57 -0.01 0.00 0.47 0.00 0.00 36.82 39.06 2k6q h ILE 95 CO 0.65 0.00 -0.19 0.77 -3.07 0.00 0.00 178.15 176.30 2k6q h SER 96 N 0.00 0.93 0.00 2.19 4.64 -1.86 -2.44 113.55 117.01 2k6q h SER 96 Ca 0.11 -0.40 -0.04 0.00 -0.47 0.00 0.00 61.79 60.99 2k6q h SER 96 Cb 1.08 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.90 2k6q h SER 96 CO -0.00 1.12 -0.30 -0.33 -0.87 0.00 0.00 176.83 176.45 2k6q h GLU 97 N 0.74 0.00 -1.36 4.77 4.39 0.06 -2.83 114.58 120.35 2k6q h GLU 97 Ca 0.10 0.00 0.43 0.00 0.34 0.00 0.00 59.36 60.23 2k6q h GLU 97 Cb 0.76 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 29.30 2k6q h GLU 97 CO 0.06 0.64 0.90 0.28 -1.16 0.00 0.00 179.01 179.73 2k6q h VAL 98 N -1.00 0.16 0.15 3.13 2.07 -0.81 1.69 116.25 121.64 2k6q h VAL 98 Ca -0.07 -0.03 -0.31 0.00 0.82 0.00 0.00 66.70 67.11 2k6q h VAL 98 Cb 0.76 0.06 0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2k6q h VAL 98 CO -0.04 0.02 -1.30 0.22 0.02 0.00 0.00 177.57 176.49 2k6q h TYR 99 N 0.10 0.95 0.00 1.57 5.03 -1.53 -2.39 116.97 120.70 2k6q h TYR 99 Ca 0.80 -0.63 0.00 0.00 2.58 0.00 0.00 58.73 61.48 2k6q h TYR 99 Cb 2.60 -0.07 0.00 0.00 1.55 0.00 0.00 36.73 40.81 2k6q h TYR 99 CO -0.00 1.47 0.00 -0.85 -1.32 0.00 0.00 178.16 177.46 2k6q n GLU 100 N -3.75 0.53 -0.05 1.82 0.28 0.49 0.11 120.64 120.07 2k6q n GLU 100 Ca -0.14 0.02 0.03 0.00 -0.16 0.00 0.00 57.16 56.91 2k6q n GLU 100 Cb 1.02 -1.50 0.05 0.00 1.43 0.00 0.00 31.44 32.44 2k6q n GLU 100 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2k6q n SER 101 N -1.21 1.99 0.05 -1.84 7.64 0.34 -4.77 113.62 115.82 2k6q n SER 101 Ca 0.15 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.39 2k6q n SER 101 Cb 0.19 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2k6q n SER 101 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k6q n GLU 102 N 0.14 0.00 -0.93 1.43 -0.58 -0.91 -5.01 120.64 114.78 2k6q n GLU 102 Ca 0.05 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.49 2k6q n GLU 102 Cb 0.24 -0.09 0.01 0.00 -0.57 0.00 0.00 31.44 31.04 2k6q n GLU 102 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2k6q n ARG 103 N -2.93 0.00 -2.62 3.49 -4.01 0.31 -4.97 116.66 105.92 2k6q n ARG 103 Ca 0.00 0.00 -0.13 0.00 -1.04 0.00 0.00 57.85 56.68 2k6q n ARG 103 Cb 0.05 -0.78 0.00 0.00 -3.04 0.00 0.00 32.46 28.69 2k6q n ARG 103 CO 0.00 0.00 0.00 -3.47 -3.04 0.00 0.00 177.63 171.12 2k6q n ASP 104 N 2.14 1.81 -0.22 2.89 2.03 -1.26 -4.90 116.55 119.04 2k6q n ASP 104 Ca 0.04 -1.96 0.31 0.00 0.52 0.00 0.00 54.79 53.70 2k6q n ASP 104 Cb 0.38 -0.04 0.73 0.00 -0.72 0.00 0.00 41.12 41.47 2k6q n ASP 104 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2k6q h GLU 105 N 0.00 0.00 -0.24 -0.67 4.39 -1.96 0.41 114.58 116.50 2k6q h GLU 105 Ca -0.18 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 2k6q h GLU 105 Cb 0.66 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 2k6q h GLU 105 CO 0.27 0.00 0.10 0.38 -1.16 0.00 0.00 179.01 178.60 2k6q h ASP 106 N 0.00 0.33 0.00 1.42 3.04 -1.94 -3.47 116.42 115.79 2k6q h ASP 106 Ca 0.47 -0.16 0.00 0.00 -3.24 0.00 0.00 57.03 54.10 2k6q h ASP 106 Cb 1.89 -0.09 0.00 0.00 -1.04 0.00 0.00 39.33 40.10 2k6q h ASP 106 CO -0.00 0.40 0.00 0.61 -2.04 0.00 0.00 179.24 178.20 2k6q n GLY 107 N -0.73 0.98 3.42 7.15 0.00 0.14 -4.65 105.19 111.51 2k6q n GLY 107 Ca -0.03 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 2k6q n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k6q s PHE 108 N -2.00 2.91 0.15 1.61 0.08 -1.26 -4.67 117.98 114.80 2k6q s PHE 108 Ca 0.00 -0.52 -0.30 0.00 0.12 0.00 0.00 56.93 56.23 2k6q s PHE 108 Cb 0.00 -1.91 -0.07 0.00 -0.57 0.00 0.00 43.02 40.47 2k6q s PHE 108 CO 0.00 -0.16 1.01 -0.51 -0.10 0.00 0.00 175.22 175.46 2k6q s LEU 109 N 0.43 4.51 -0.30 -0.37 2.01 -1.13 -4.30 118.68 119.53 2k6q s LEU 109 Ca -0.07 1.91 0.01 0.00 0.01 0.00 0.00 54.13 55.99 2k6q s LEU 109 Cb -0.15 -3.60 0.07 0.00 0.01 0.00 0.00 46.19 42.52 2k6q s LEU 109 CO 0.04 -0.09 -0.02 -0.31 1.01 0.00 0.00 176.35 176.98 2k6q s TYR 110 N -0.22 3.37 -0.03 0.29 2.02 -1.26 0.11 117.35 121.62 2k6q s TYR 110 Ca 0.47 -2.25 0.02 0.00 -0.37 0.00 0.00 57.07 54.94 2k6q s TYR 110 Cb -0.26 -2.26 0.01 0.00 -0.40 0.00 0.00 41.96 39.05 2k6q s TYR 110 CO 0.32 -0.87 -0.08 -1.64 -1.57 0.00 0.00 175.55 171.71 2k6q s MET 111 N 1.14 0.90 -0.12 -0.62 -1.94 -1.15 -1.18 119.30 116.32 2k6q s MET 111 Ca -0.03 -0.26 -0.03 0.00 -1.71 0.00 0.00 55.69 53.66 2k6q s MET 111 Cb -0.20 -0.85 -0.03 0.00 2.01 0.00 0.00 34.83 35.76 2k6q s MET 111 CO -0.04 0.08 0.01 0.08 -0.01 0.00 0.00 175.02 175.13 2k6q s VAL 112 N 0.30 4.33 0.16 -6.03 1.01 0.54 -2.20 120.40 118.52 2k6q s VAL 112 Ca -0.05 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 61.79 2k6q s VAL 112 Cb -0.09 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2k6q s VAL 112 CO 0.00 0.55 -0.03 -0.72 0.00 0.00 0.00 175.10 174.91 2k6q s TYR 113 N -0.34 2.82 0.29 5.22 -0.85 -1.14 0.55 117.35 123.89 2k6q s TYR 113 Ca 0.07 -0.14 -0.19 0.00 -0.52 0.00 0.00 57.07 56.29 2k6q s TYR 113 Cb -0.12 -1.38 0.06 0.00 0.38 0.00 0.00 41.96 40.90 2k6q s TYR 113 CO 0.02 0.50 0.89 0.00 -1.52 0.00 0.00 175.55 175.45 2k6q s ALA 114 N -1.63 -1.14 -0.64 9.51 0.00 -0.74 -2.69 121.76 124.42 2k6q s ALA 114 Ca 0.26 -0.52 0.07 0.00 0.00 0.00 0.00 51.96 51.77 2k6q s ALA 114 Cb -0.10 0.71 0.41 0.00 0.00 0.00 0.00 23.12 24.15 2k6q s ALA 114 CO 0.18 -1.02 1.13 -1.13 0.00 0.00 0.00 175.76 174.91 2k6q n SER 115 N -1.24 3.36 -3.75 0.00 3.41 -1.26 -0.48 113.62 113.65 2k6q n SER 115 Ca -0.06 -2.46 -0.13 0.00 -0.26 0.00 0.00 58.87 55.96 2k6q n SER 115 Cb 0.60 -0.59 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 2k6q n SER 115 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2k6q s GLN 116 N -1.88 0.69 0.00 4.33 0.74 -1.26 -4.60 119.66 117.68 2k6q s GLN 116 Ca 0.27 -0.18 0.00 0.00 0.05 0.00 0.00 55.36 55.50 2k6q s GLN 116 Cb 0.21 0.31 0.00 0.00 1.10 0.00 0.00 33.01 34.62 2k6q s GLN 116 CO 0.08 -0.19 0.33 -1.91 -0.55 0.00 0.00 175.29 173.05 2k6q n GLU 117 N 1.24 0.32 -2.97 1.67 2.13 -1.26 -4.62 120.64 117.15 2k6q n GLU 117 Ca -0.21 -0.33 -0.18 0.00 0.66 0.00 0.00 57.16 57.10 2k6q n GLU 117 Cb 0.56 -0.81 -0.01 0.00 0.27 0.00 0.00 31.44 31.44 2k6q n GLU 117 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2k6q n THR 118 N -0.14 0.79 -0.05 6.31 -2.24 -1.26 -4.75 114.28 112.94 2k6q n THR 118 Ca 0.00 -4.37 -0.14 0.00 -2.27 0.00 0.00 64.05 57.27 2k6q n THR 118 Cb 0.04 -0.26 -0.14 0.00 -2.10 0.00 0.00 70.33 67.86 2k6q n THR 118 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 2k6q n PHE 119 N 0.06 0.66 -0.24 4.78 -1.74 -1.26 -5.27 117.46 114.44 2k6q n PHE 119 Ca 0.23 0.19 0.00 0.00 -0.56 0.00 0.00 57.45 57.31 2k6q n PHE 119 Cb 0.66 -1.11 0.00 0.00 1.52 0.00 0.00 39.48 40.56 2k6q n PHE 119 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61